Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | IGF1R | P08069 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.35 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.35 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8203447 | 0.82 | SMN1; SMN2 (0.36) | HDAC8HDAC1SMN1; SMN2 | |
| SCHEMBL720169 | 0.81 | CYP3A4 (0.38) | TDP1PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL29695439 | 0.79 | CYP3A4 (0.36) | TDP1PTGER1PTGER4PTGER3PTGER2 | |
| Phosphine SCHEMBL29173742 | 0.79 | CYP3A4 (0.36) | TDP1PTGER1PTGER4PTGER3PTGER2 | |
| Lithium SCHEMBL29695298 | 0.79 | CYP3A4 (0.36) | TDP1PTGER1PTGER4PTGER3PTGER2 | |
| Potassium SCHEMBL30843013 | 0.79 | CYP3A4 (0.36) | TDP1PTGER1PTGER4PTGER3PTGER2 | |
| Bromide SCHEMBL30945893 | 0.77 | CYP3A4 (0.35) | TDP1 | |
| SCHEMBL19002937 | 0.76 | CSNK2A2 (0.30) | — | |
| SCHEMBL8056033 | 0.75 | PTGS2 (0.33) | TDP1 | |
| SCHEMBL30945894 | 0.74 | DPP4 (0.32) | TDP1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6043398-A | WATER-SOLUBLE, SULFONATED DIPHOSPHINES COMPLEXED WITH A TRANSITION METAL TO FORM HYDROFORMYLATION CATALYSTS; OUTSTANDING SURFACE ACTIVE PROPERTIES IN TWO PHASE CATALYSIS OF TWO PHASE HYDROFORMYLATION OF OCT-1-ENE OLEFINS | CELANESE INTERNATIONAL CORPORATION (US) | 2000-03-28 | — | — | US | disclosed |